2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol

C14H27NO — CID 106663968

IUPAC2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol
SMILESCC1CCNC(C2(O)CC(C)(C)CC2C)C1
InChIInChI=1S/C14H27NO/c1-10-5-6-15-12(7-10)14(16)9-13(3,4)8-11(14)2/h10-12,15-16H,5-9H2,1-4H3
InChIKeyPWJHBVYALCQWIS-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.56
Rot. Bonds1

About 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol

2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol (PubChem CID 106663968) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol
PubChem CID106663968
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol
SMILESCC1CCNC(C2(O)CC(C)(C)CC2C)C1
InChIInChI=1S/C14H27NO/c1-10-5-6-15-12(7-10)14(16)9-13(3,4)8-11(14)2/h10-12,15-16H,5-9H2,1-4H3
InChIKeyPWJHBVYALCQWIS-UHFFFAOYSA-N
XLogP2.56
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol?
The IUPAC name of 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol (CID 106663968) is 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol.
What is the SMILES notation for 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol?
The canonical SMILES for 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol is CC1CCNC(C2(O)CC(C)(C)CC2C)C1.
What is the InChIKey of 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol?
The InChIKey is PWJHBVYALCQWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-10-5-6-15-12(7-10)14(16)9-13(3,4)8-11(14)2/h10-12,15-16H,5-9H2,1-4H3.
What are the key properties of 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol?
2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.56, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,4-trimethyl-1-(4-methylpiperidin-2-yl)cyclopentan-1-ol is sourced from PubChem (CID 106663968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).